N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-hydroxy-1-naphthyl]-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-[3-(1H-benzimidazol-2-ylthio)-4-hydroxy-1-naphthalenyl]-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(1H-benzimidazol-2-ylsulfanyl)-4-hydroxynaphthalen-1-yl]-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-[3-(1H-benzimidazol-2-ylthio)-4-hydroxy-1-naphthyl]-4-methoxy-3-nitro-benzenesulfonamide Formula: C24H18N4O6S2 MolecularWeight: 522.55292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC4=NC5=CC=CC=C5N4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC4=NC5=CC=CC=C5N4)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O6S2/c1-34-21-11-10-14(12-20(21)28(30)31)36(32,33)27-19-13-22(23(29)16-7-3-2-6-15(16)19)35-24-25-17-8-4-5-9-18(17)26-24/h2-13,27,29H,1H3,(H,25,26)